Molecule ID: mol12963
SMILES: CN(C)[C@H]1CCC[C@@H]1C#N
InChI: InChI=1S/C8H14N2/c1-10(2)8-5-3-4-7(8)6-9/h7-8H,3-5H2,1-2H3/t7-,8+/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.02 | QSARToolbox | 1 » 0 |
| 7.02 | QSARToolbox | 1 » 0 |
| 7.02 | Datawarrior | 1 » 0 |